![4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID structure](/static/products/6568/656818-39-2.webp)
4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID
TL;DR: 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID (CAS 656818-39-2) is a chemical compound with molecular formula C23H26BrClN2O3S and molecular weight 524.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(3-bromophenyl)methyl-[(5-chloro-2-methoxyphenyl)carbamothioyl]amino]methyl]cyclohexane-1-carboxylic acid
Also Known As: 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID, 4-[[(3-bromophenyl)methyl-[(5-chloro-2-methoxyphenyl)carbamothioyl]amino]methyl]cyclohexane-1-carboxylic acid, 4-[[[(3-Bromophenyl)methyl][[(5-chloro-2-methoxyphenyl)amino]thioxomethyl]amino]methyl]cyclohexanecarboxylic acid
| Molecular Formula | C23H26BrClN2O3S |
|---|---|
| Molecular Weight | 524.05 g/mol |
| LogP | 6.2011 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 524.0536 |
| Heavy Atoms | 31 |
| Complexity | 934.78766 |
Chemical Identifiers
| CAS Number | 656818-39-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)NC(=S)N(CC2CCC(CC2)C(=O)O)CC3=CC(=CC=C3)Br |
Product Overview
4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID (CAS 656818-39-2), with molecular formula C23H26BrClN2O3S and molecular weight 524.05 g/mol. IUPAC: 4-[[(3-bromophenyl)methyl-[(5-chloro-2-methoxyphenyl)carbamothioyl]amino]methyl]cyclohexane-1-carboxylic acid.
Chemical Property Profile of 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID
Property Insights of 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID
The XLogP value of 6.2011 indicates that 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID. Following Lipinski's Rule of Five, 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID?
The CAS number of 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID is 656818-39-2.
What is the molecular formula of 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID?
The molecular formula of 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID is C23H26BrClN2O3S.
What is the molecular weight of 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID?
The molecular weight of 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID is 524.05 g/mol.
Where can I buy 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID?
You can request a quote for 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID?
Yes, KEHONG BIO provides custom synthesis services for 4-({[(3-BROMOPHENYL)METHYL][(5-CHLORO-2-METHOXYPHENYL)CARBAMOTHIOYL]AMINO}METHYL)CYCLOHEXANE-1-CARBOXYLIC ACID and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.